In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2009 | 26 | Yes |
Popular Name: 1-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)sulfonyl-4-[(3-fluorophenyl)methyl]piperazine 1-(1-ethyl-3,5-dimethyl-pyrazol-…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.88 | 5.65 | -12.58 | 0 | 6 | 0 | 58 | 380.489 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.88 | 7.87 | -54.67 | 1 | 6 | 1 | 60 | 381.497 | 5 | ↓ |